Ecosyste.ms: Issues

An open API service for providing issue and pull request metadata for open source projects.

GitHub / libAtoms/ExtXYZ.jl issues and pull requests

#46 - Reading in frames from an IOBuffer

Issue - State: closed - Opened by joegilkes about 1 year ago - 8 comments

#45 - Fix for issue #44 - update to extxyz_jll v0.1.3

Pull Request - State: closed - Opened by jameskermode about 1 year ago - 1 comment

#44 - Read error

Issue - State: closed - Opened by JPDarby about 1 year ago - 7 comments

#43 - codecov

Pull Request - State: closed - Opened by jameskermode about 1 year ago - 1 comment

#42 - Fixes for issue 33 - zero atoms and empty file

Pull Request - State: closed - Opened by jameskermode about 1 year ago

#41 - test for issue #37

Pull Request - State: closed - Opened by jameskermode about 1 year ago

#40 - fix to doc building environment

Pull Request - State: closed - Opened by jameskermode about 1 year ago

#39 - Fix for issue #37 - missing cell in extxyz files

Pull Request - State: closed - Opened by jameskermode about 1 year ago - 1 comment

#38 - Fix a bug in AtomsBase interface

Pull Request - State: closed - Opened by tjjarvinen about 1 year ago - 1 comment

#37 - Files with missing cell

Issue - State: closed - Opened by cortner over 1 year ago - 2 comments

#36 - Increase test tolerance a little

Pull Request - State: closed - Opened by mfherbst over 1 year ago - 1 comment

#35 - xyz file produced by LAMMPS cannot be parsed

Issue - State: open - Opened by mfherbst over 1 year ago - 2 comments

#34 - Errors in parsing should throw an exception

Issue - State: open - Opened by mfherbst over 1 year ago - 2 comments

#33 - Segfault on empty xyz file

Issue - State: closed - Opened by mfherbst over 1 year ago - 1 comment

#32 - Integrate with AtomsBaseTesting

Pull Request - State: closed - Opened by mfherbst over 1 year ago - 6 comments

#31 - Setup coverage tracking

Issue - State: closed - Opened by mfherbst almost 2 years ago - 3 comments

#30 - Bugfix in default velocity of dict constructor

Pull Request - State: closed - Opened by mfherbst almost 2 years ago - 1 comment

#29 - Integrate with AtomsBase 0.3

Pull Request - State: closed - Opened by mfherbst almost 2 years ago - 5 comments

#28 - Ensure pointer is not NULL before calling fclose()

Pull Request - State: closed - Opened by jameskermode almost 2 years ago - 1 comment

#27 - Segfault when reading non-existent file

Issue - State: closed - Opened by mfherbst almost 2 years ago - 8 comments

#26 - Issues with AtomsBase interface

Issue - State: closed - Opened by mfherbst almost 2 years ago - 1 comment

#25 - velocity(s::Atoms) throws an error if velocities are not defined

Pull Request - State: closed - Opened by KaiLiersch about 2 years ago - 2 comments

#24 - Rename properties in AtomsBase Interface

Issue - State: closed - Opened by JanHab about 2 years ago - 2 comments

#23 - velocity for AtomsBase interface

Issue - State: closed - Opened by JanHab about 2 years ago

#22 - set velocities per default on zero in AtomsBase interface

Issue - State: closed - Opened by JanHab about 2 years ago - 1 comment

#21 - show_system for AtomsBase interface

Issue - State: closed - Opened by JanHab about 2 years ago - 5 comments

#20 - interface for arbitrary properties

Issue - State: closed - Opened by JanHab about 2 years ago - 3 comments

#19 - added Units for AtomsBase interface + a Base.show routine

Pull Request - State: closed - Opened by JanHab about 2 years ago - 13 comments

#18 - Release 0.1.5

Pull Request - State: closed - Opened by jameskermode over 2 years ago

#17 - Add support for molecular xyzs without Lattice key

Pull Request - State: closed - Opened by joegilkes over 2 years ago - 1 comment

#16 - (Request) Support for molecular XYZs without Lattice key

Issue - State: closed - Opened by joegilkes over 2 years ago - 6 comments

#15 - Experimental AtomsBase interface

Pull Request - State: closed - Opened by jameskermode over 2 years ago - 10 comments

#14 - New version: v0.1.4

Pull Request - State: closed - Opened by jameskermode over 3 years ago

#13 - Fix testing and transpose bug

Pull Request - State: closed - Opened by jameskermode over 3 years ago - 2 comments

#12 - Fix isapprox for dictionaries in testing (and highlight existing errors)

Pull Request - State: closed - Opened by jamesgardner1421 over 3 years ago - 3 comments

#11 - New version: v0.1.3

Pull Request - State: closed - Opened by jameskermode over 3 years ago

#10 - Fix column ordering when writing files with only positions and species

Pull Request - State: closed - Opened by jamesgardner1421 over 3 years ago - 1 comment

#9 - New version: v0.1.2

Pull Request - State: closed - Opened by jameskermode over 3 years ago

#8 - Incorrect file to dict transformation with multiple atoms

Issue - State: closed - Opened by jamesgardner1421 over 3 years ago - 3 comments

#7 - New version: v0.1.1

Pull Request - State: closed - Opened by jameskermode over 3 years ago

#6 - InitError on Windows loading libcleri.dll

Issue - State: closed - Opened by jamesgardner1421 over 3 years ago - 7 comments

#5 - TagBot trigger issue

Issue - State: closed - Opened by JuliaTagBot over 3 years ago - 15 comments

#4 - New version: v0.1.0

Pull Request - State: closed - Opened by jameskermode over 3 years ago - 2 comments

#3 - JuLIP Dependency

Issue - State: closed - Opened by cortner over 3 years ago - 5 comments

#1 - Related packages

Issue - State: closed - Opened by cortner over 3 years ago - 8 comments